| SpectraBase Compound ID | 5yCRNaKJpgv |
|---|---|
| InChI | InChI=1S/C13H12F4O2/c14-12(15)13(16,17)7-19-11(18)10-6-9(10)8-4-2-1-3-5-8/h1-5,9-10,12H,6-7H2 |
| InChIKey | DXPQVJBVQPBVMP-UHFFFAOYSA-N |
| Mol Weight | 276.23 g/mol |
| Molecular Formula | C13H12F4O2 |
| Exact Mass | 276.077342 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 24mmfGuMEEd |
|---|---|
| Name | Cyclopropanecarboxylic acid, trans-2-phenyl-, 2,2,3,3-tetrafluoropropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.077342276 u |
| Formula | C13H12F4O2 |
| InChI | InChI=1S/C13H12F4O2/c14-12(15)13(16,17)7-19-11(18)10-6-9(10)8-4-2-1-3-5-8/h1-5,9-10,12H,6-7H2 |
| InChIKey | DXPQVJBVQPBVMP-UHFFFAOYSA-N |
| Molecular Weight | 276.231 g/mol |
| SMILES | C1C(C2=CC=CC=C2)C1C(OCC(C(F)F)(F)F)=O |